Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | STAT3 | P40763 | 2/20 | 0.42 |
| ▸ | DHODH | Q02127 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.37 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | MMP1 | P03956 | 1/20 | 0.37 |
| ▸ | MMP2 | P08253 | 1/20 | 0.37 |
| ▸ | MMP9 | P14780 | 1/20 | 0.37 |
| ▸ | MMP8 | P22894 | 1/20 | 0.37 |
| ▸ | MMP13 | P45452 | 1/20 | 0.37 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL16488723 | 1.00 | STAT3 (0.42) | STAT3DHODHALDH1A1GAAKDM4E | |
| SCHEMBL2225063 | 1.00 | STAT3 (0.42) | STAT3DHODHALDH1A1GAAKDM4E | |
| SCHEMBL16468235 | 1.00 | STAT3 (0.42) | STAT3DHODHALDH1A1GAAKDM4E | |
| SCHEMBL70900 | 0.93 | STAT3 (0.46) | STAT3DHODHALDH1A1GAACYP2D6 | |
| SCHEMBL70901 | 0.93 | STAT3 (0.46) | STAT3DHODHALDH1A1GAACYP2D6 | |
| SCHEMBL1730532 | 0.93 | STAT3 (0.46) | STAT3DHODHALDH1A1GAACYP2D6 | |
| SCHEMBL15187558 | 0.91 | STAT3 (0.40) | STAT3DHODHALDH1A1GAAKDM4E | |
| SCHEMBL13536697 | 0.88 | CA2 (0.43) | STAT3DHODHALDH1A1GAAKDM4E | |
| SCHEMBL12517684 | 0.88 | CA12 (0.44) | STAT3DHODHALDH1A1GAAKDM4E | |
| SCHEMBL15189067 | 0.87 | STAT3 (0.43) | STAT3DHODHALDH1A1GAAKDM4E |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011087995-A2 | ORGANIC COMPOUNDS | BARRY CLIFTON (US) | 2011-07-21 | — | — | WO | disclosed |
| EP-2172444-A1 | PET PROBE HAVING ALKOXY GROUP SUBSTITUTED BY FLUORINE AND HYDROXY GROUP | Tohoku University (JP) | 2010-04-07 | — | — | EP | disclosed |